SCHEMBL29567415

SCHEMBL29567415

COc1cccc(Cn2c(=O)oc3ccc(F)cc32)c1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MIF P14174 5/20 0.77
IDO1 P14902 5/20 0.75
CD74 P04233 4/20 0.75
POLB P06746 3/20 0.74
CBX7 O95931 1/20 0.66
CDYL2 Q8N8U2 1/20 0.66
CDYL Q9Y232 1/20 0.66
TNIK Q9UKE5 5/20 0.58
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18805688 1.00 MIF (0.77) MIFIDO1CD74POLBCBX7
SCHEMBL18805674 0.91 POLB (0.74) MIFIDO1CD74POLBCBX7
SCHEMBL29566319 0.90 MIF (0.84) MIFIDO1CD74POLBCBX7
SCHEMBL244817 0.90 MIF (0.84) MIFIDO1CD74POLBCBX7
SCHEMBL2757851 0.87 MIF (1.00) MIFCD74POLBTNIKKMT2A
SCHEMBL18805695 0.86 IDO1 (0.72) MIFIDO1CD74POLBCBX7
SCHEMBL18805687 0.86 MIF (0.77) MIFIDO1CD74POLBCBX7
SCHEMBL18805682 0.86 MIF (1.00) MIFIDO1CD74POLBCBX7
SCHEMBL29566444 0.86 MIF (0.77) MIFIDO1CD74POLBCBX7
SCHEMBL29566638 0.86 MIF (1.00) MIFIDO1CD74POLBCBX7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4237002-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF University Health Network (CA) 2023-09-06 EP disclosed
WO-2022087719-A1 METHODS OF TREATING SPONDYLOARTHRITIS OR SYMPTOMS THEREOF UNIVERSITY HEALTH NETWORK (CA) 2022-05-05 WO disclosed